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Methyl 2-(3',3'-diethyltriaz-1'-enyl)-5-iodobenzoate
SpectraBase Compound ID GwrDTQI1kQf
InChI InChI=1S/C12H16IN3O2/c1-4-16(5-2)15-14-11-7-6-9(13)8-10(11)12(17)18-3/h6-8H,4-5H2,1-3H3/b15-14+
InChIKey UCFPBJZABPKFOF-CCEZHUSRSA-N
Mol Weight 361.18 g/mol
Molecular Formula C12H16IN3O2
Exact Mass 361.028722 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CCu8sOGyaLK
Name Methyl 2-(3',3'-diethyltriaz-1'-enyl)-5-iodobenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16IN3O2
InChI InChI=1S/C12H16IN3O2/c1-4-16(5-2)15-14-11-7-6-9(13)8-10(11)12(17)18-3/h6-8H,4-5H2,1-3H3/b15-14+
InChIKey UCFPBJZABPKFOF-CCEZHUSRSA-N
Molecular Weight 361.183 g/mol
SMILES c1(C(=O)OC)c(\N=N\N(CC)CC)ccc(c1)I
SPLASH splash10-03di-0091000000-8b5ea25f492c61862668
Source of Spectrum H-84-2280-42
Synonyms Methyl 2-[(1E)-3,3-diethyl-1-triazenyl]-5-iodobenzoate
Wiley ID 847696